SCHEMBL3682835

SCHEMBL3682835

N=C(c1c(-c2cccc3c2Cc2ccccc2-3)ccc2ccccc12)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 4/20 0.36
HTR1A P08908 2/20 0.36
PNMT P11086 1/20 0.35
RAB9A P51151 3/20 0.34
NPC1 O15118 1/20 0.34
KCNJ11 Q14654 1/20 0.33
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
CNR1 P21554 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
TAS1R2 Q8TE23 1/20 0.32
MAPT P10636 1/20 0.32
MPI P34949 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3681694 0.80 HTR7 (0.41) HTR7PNMTRAB9ANPC1ALDH1A1
SCHEMBL3677255 0.80 PNMT (0.35) HTR7HTR1APNMTRAB9ANPC1
SCHEMBL3202297 0.76 CNR1 (0.38) RAB9AKCNJ11ALDH1A1KDM4ELMNA
SCHEMBL3676091 0.76 NPC1 (0.40) HTR7HTR1APNMTRAB9ANPC1
SCHEMBL3672074 0.76 PNMT (0.38) HTR7HTR1APNMTRAB9ANPC1
SCHEMBL3224106 0.74 PNMT (0.46) HTR7HTR1APNMTRAB9ANPC1
SCHEMBL3216950 0.73 TAS1R3 (0.38) RAB9AKCNJ11ALDH1A1KDM4ELMNA
SCHEMBL3671422 0.73 NPC1 (0.33) HTR7HTR1APNMTRAB9ANPC1
SCHEMBL6675750 0.73 PNMT (0.50) HTR7HTR1APNMTRAB9ANPC1
Benzo(A)Fluorene SCHEMBL150250 0.73 CA1 (0.46) HTR7HTR1APNMTRAB9ANPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732643-B2 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-08 US disclosed
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME HANAOKA HIDENORI 2010-02-25 US disclosed
US-20090054607-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same HANAOKA HIDENORI 2009-02-26 US disclosed
US-20040242410-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-12-02 US disclosed
EP-1426379-A1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME Sumitomo Chemical Company, Limited (JP) 2004-06-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090054607-A1 Transition metal complex, catalyst for olefin polymerization, and process for producing olefin polymer with the same C1R, C1S, AP1M1 HTR7 3440/4885HTR1A 1017/4885PNMT 1804/4885
US-20100048933-A1 TRANSITION METAL COMPLEX, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME C1R, C1S, AP1M1 HTR7 3440/4885HTR1A 1017/4885PNMT 1804/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.